5-(4-methylpiperidin-1-yl)-4-nitro-N-quinolin-6-yl-2,1,3-benzoxadiazol-7-amine

Systemtic Name: 5-(4-methylpiperidin-1-yl)-4-nitro-N-quinolin-6-yl-2,1,3-benzoxadiazol-7-amine Openeye Name: 5-(4-methyl-1-piperidyl)-4-nitro-N-(6-quinolyl)-2,1,3-benzoxadiazol-7-amine CAS Name: 5-(4-methyl-1-piperidinyl)-4-nitro-N-(6-quinolinyl)-2,1,3-benzoxadiazol-7-amine IUPAC Name: 5-(4-methylpiperidin-1-yl)-4-nitro-N-quinolin-6-yl-2,1,3-benzoxadiazol-7-amine Traditional Name: [6-(4-methylpiperidino)-7-nitro-benzofurazan-4-yl]-(6-quinolyl)amine Formula: C21H20N6O3 MolecularWeight: 404.4219

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C3=NON=C3C(=C2)NC4=CC5=C(C=C4)N=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C3=NON=C3C(=C2)NC4=CC5=C(C=C4)N=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O3/c1-13-6-9-26(10-7-13)18-12-17(19-20(25-30-24-19)21(18)27(28)29)23-15-4-5-16-14(11-15)3-2-8-22-16/h2-5,8,11-13,23H,6-7,9-10H2,1H3